SCHEMBL6205745

SCHEMBL6205745

Cc1nn(C)c(Cl)c1S(=O)(O)=S

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.44
FPR2 P25090 6/20 0.40
PROKR1 Q8TCW9 6/20 0.40
MCL1 Q07820 1/20 0.40
ACLY P53396 2/20 0.40
HTR6 P50406 1/20 0.38
GAA P10253 1/20 0.36
NMT1 P30419 2/20 0.36
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 2/20 0.34
CCR2 P41597 1/20 0.34
POLB P06746 1/20 0.33
APEX1 P27695 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2650212 0.85 L3MBTL1 (0.46) L3MBTL1FPR2PROKR1MCL1ACLY
Fluoride SCHEMBL27733765 0.83 L3MBTL1 (0.45) L3MBTL1FPR2PROKR1MCL1ACLY
Hydrochloric Acid SCHEMBL27293487 0.83 L3MBTL1 (0.45) L3MBTL1FPR2PROKR1MCL1ACLY
SCHEMBL388129 0.79 L3MBTL1 (0.43) L3MBTL1FPR2PROKR1MCL1ACLY
SCHEMBL1641772 0.79 L3MBTL1 (0.43) L3MBTL1FPR2PROKR1MCL1ACLY
SCHEMBL4636620 0.77 MCL1 (0.48) L3MBTL1FPR2PROKR1MCL1ACLY
SCHEMBL1626536 0.77 L3MBTL1 (0.42) L3MBTL1FPR2PROKR1MCL1ACLY
SCHEMBL3941116 0.77 L3MBTL1 (0.42) L3MBTL1FPR2PROKR1MCL1ACLY
SCHEMBL15882311 0.76 ACLY (0.50) L3MBTL1FPR2PROKR1MCL1ACLY
SCHEMBL13677614 0.76 HTR6 (0.44) L3MBTL1FPR2PROKR1MCL1ACLY

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539141-A1 -3 (SULFONAMIDOETHYL) -INDOLE DERIVATIES FOR USE AS GLUCOCORTICOID MIMETICS IN THE TREATMENT OF INFLAMMATORY, ALLERGIC AND PROLIFERATIVE DISEASES BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2005-06-15 EP claimed
US-20040097574-A1 Glucocorticoid mimetics, methods of making them, pharmaceutical compositions, and uses thereof BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2004-05-20 US claimed
WO-2004019935-A1 -3 (SULFONAMIDOETHYL) -INDOLE DERIVATIES FOR USE AS GLUCOCORTICOID MIMETICS IN THE TREATMENT OF INFLAMMATORY, ALLERGIC AND PROLIFERATIVE DISEASES BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2004-03-11 WO claimed
EP-1539141-A1 -3 (SULFONAMIDOETHYL) -INDOLE DERIVATIES FOR USE AS GLUCOCORTICOID MIMETICS IN THE TREATMENT OF INFLAMMATORY, ALLERGIC AND PROLIFERATIVE DISEASES BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2005-06-15 EP disclosed
WO-2004019935-A1 -3 (SULFONAMIDOETHYL) -INDOLE DERIVATIES FOR USE AS GLUCOCORTICOID MIMETICS IN THE TREATMENT OF INFLAMMATORY, ALLERGIC AND PROLIFERATIVE DISEASES BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2004-03-11 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040097574-A1 Glucocorticoid mimetics, methods of making them, pharmaceutical compositions, and uses thereof NR3C1, NR3C2, MC2R L3MBTL1 3888/4885FPR2 65/4885PROKR1 157/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.